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Home > Bromides > 1630907-03-7
1630907-03-7 | 1H-Pyrazole, 5-bromo-1,3-dimethyl-, hydrobromide (1:1)
CAS No: 1630907-03-7 Catalog No: AG001TQK MDL No:MFCD27987125
Product Description
Catalog Number:
AG001TQK
Chemical Name:
1H-Pyrazole, 5-bromo-1,3-dimethyl-, hydrobromide (1:1)
CAS Number:
1630907-03-7
Molecular Formula:
C5H8Br2N2
Molecular Weight:
255.9384
MDL Number:
MFCD27987125
IUPAC Name:
5-bromo-1,3-dimethylpyrazole;hydrobromide
InChI:
InChI=1S/C5H7BrN2.BrH/c1-4-3-5(6)8(2)7-4;/h3H,1-2H3;1H
InChI Key:
GZYIXMGVPCLVBQ-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)Br)C.Br
Properties
Complexity:
86.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.903g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.941g/mol
Monoisotopic Mass:
253.905g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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